Schulten K - Search Results

1

Structural mechanism of voltage-dependent gating in an isolated voltage-sensing domain.

Li Q, Wanderling S, Paduch M, Medovoy D, Singharoy A, McGreevy R, Villalba-Galea CA, Hulse RE, Roux B, Schulten K, Kossiakoff A, Perozo E. Li Q, et al. Among authors: schulten k. Nat Struct Mol Biol. 2014 Mar;21(3):244-52. doi: 10.1038/nsmb.2768. Epub 2014 Feb 2. Nat Struct Mol Biol. 2014. PMID: 24487958 Free PMC article.

2

Three-dimensional architecture of membrane-embedded MscS in the closed conformation.

Vásquez V, Sotomayor M, Cortes DM, Roux B, Schulten K, Perozo E. Vásquez V, et al. Among authors: schulten k. J Mol Biol. 2008 Apr 18;378(1):55-70. doi: 10.1016/j.jmb.2007.10.086. Epub 2007 Nov 9. J Mol Biol. 2008. PMID: 18343404 Free PMC article.

3

A structural mechanism for MscS gating in lipid bilayers.

Vásquez V, Sotomayor M, Cordero-Morales J, Schulten K, Perozo E. Vásquez V, et al. Among authors: schulten k. Science. 2008 Aug 29;321(5893):1210-4. doi: 10.1126/science.1159674. Science. 2008. PMID: 18755978 Free PMC article.

4

Calculation of the gating charge for the Kv1.2 voltage-activated potassium channel.

Khalili-Araghi F, Jogini V, Yarov-Yarovoy V, Tajkhorshid E, Roux B, Schulten K. Khalili-Araghi F, et al. Among authors: schulten k. Biophys J. 2010 May 19;98(10):2189-98. doi: 10.1016/j.bpj.2010.02.056. Biophys J. 2010. PMID: 20483327 Free PMC article.

5

Molecular dynamics investigation of the ω-current in the Kv1.2 voltage sensor domains.

Khalili-Araghi F, Tajkhorshid E, Roux B, Schulten K. Khalili-Araghi F, et al. Among authors: schulten k. Biophys J. 2012 Jan 18;102(2):258-67. doi: 10.1016/j.bpj.2011.10.057. Biophys J. 2012. PMID: 22339862 Free PMC article.

6

An emerging consensus on voltage-dependent gating from computational modeling and molecular dynamics simulations.

Vargas E, Yarov-Yarovoy V, Khalili-Araghi F, Catterall WA, Klein ML, Tarek M, Lindahl E, Schulten K, Perozo E, Bezanilla F, Roux B. Vargas E, et al. Among authors: schulten k. J Gen Physiol. 2012 Dec;140(6):587-94. doi: 10.1085/jgp.201210873. J Gen Physiol. 2012. PMID: 23183694 Free PMC article.

7

xMDFF: molecular dynamics flexible fitting of low-resolution X-ray structures.

McGreevy R, Singharoy A, Li Q, Zhang J, Xu D, Perozo E, Schulten K. McGreevy R, et al. Among authors: schulten k. Acta Crystallogr D Biol Crystallogr. 2014 Sep;70(Pt 9):2344-55. doi: 10.1107/S1399004714013856. Epub 2014 Aug 29. Acta Crystallogr D Biol Crystallogr. 2014. PMID: 25195748 Free PMC article.

8

Structural Refinement of Proteins by Restrained Molecular Dynamics Simulations with Non-interacting Molecular Fragments.

Shen R, Han W, Fiorin G, Islam SM, Schulten K, Roux B. Shen R, et al. Among authors: schulten k. PLoS Comput Biol. 2015 Oct 27;11(10):e1004368. doi: 10.1371/journal.pcbi.1004368. eCollection 2015 Oct. PLoS Comput Biol. 2015. PMID: 26505197 Free PMC article.

9

Advances in the molecular dynamics flexible fitting method for cryo-EM modeling.

McGreevy R, Teo I, Singharoy A, Schulten K. McGreevy R, et al. Among authors: schulten k. Methods. 2016 May 1;100:50-60. doi: 10.1016/j.ymeth.2016.01.009. Epub 2016 Jan 21. Methods. 2016. PMID: 26804562 Free PMC article.

10

Computational Methodologies for Real-Space Structural Refinement of Large Macromolecular Complexes.

Goh BC, Hadden JA, Bernardi RC, Singharoy A, McGreevy R, Rudack T, Cassidy CK, Schulten K. Goh BC, et al. Among authors: schulten k. Annu Rev Biophys. 2016 Jul 5;45:253-78. doi: 10.1146/annurev-biophys-062215-011113. Epub 2016 May 2. Annu Rev Biophys. 2016. PMID: 27145875 Free PMC article. Review.

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